Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | SSTR2 | P30874 | 5/20 | 0.33 |
| ▸ | GNRHR | P30968 | 1/20 | 0.33 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7007474 | 0.87 | CHEK2 (0.34) | HSP90AA1HSP90AB1SSTR2CHEK2 | |
| SCHEMBL7009169 | 0.87 | CHEK2 (0.33) | HSP90AA1HSP90AB1SSTR2CHEK2 | |
| SCHEMBL7003860 | 0.87 | CHEK2 (0.33) | HSP90AA1HSP90AB1SSTR2CHEK2 | |
| SCHEMBL7008487 | 0.85 | HPGD (0.36) | HSP90AA1HSP90AB1SSTR2CHEK2 | |
| SCHEMBL7011908 | 0.83 | CHEK2 (0.39) | SSTR2CHEK2 | |
| SCHEMBL29038406 | 0.64 | FDPS (0.59) | HSP90AA1 | |
| SCHEMBL5701841 | 0.64 | KDM4E (0.42) | HSP90AA1HSP90AB1CHEK2 | |
| Hydrochloric Acid SCHEMBL5724531 | 0.64 | HSP90AA1 (0.41) | HSP90AA1HSP90AB1SSTR2CHEK2 | |
| SCHEMBL3580473 | 0.63 | LTA4H (0.48) | CHEK2 | |
| SCHEMBL6903897 | 0.63 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1309551-A1 | INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 2003-05-14 | — | — | EP | disclosed |
| WO-2002014273-A1 | INDOLINE DERIVATIVES AS 5HT2C ANTAGONISTS | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-02-21 | — | — | WO | disclosed |